SCHEMBL755560

SCHEMBL755560

O=Cc1ccc(Oc2ccc(Br)cc2Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.47
ALDH1A1 P00352 4/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40
HTR2A P28223 1/20 0.40
SLC6A4 P31645 1/20 0.40
KCNH2 Q12809 1/20 0.40
PDE7A Q13946 1/20 0.39
PARP10 Q53GL7 1/20 0.39
PARP3 Q9Y6F1 1/20 0.39
CYP2A6 P11509 1/20 0.39
POLB P06746 1/20 0.38
CASP6 P55212 1/20 0.38
PNLIP P16233 2/20 0.38
HSD17B10 Q99714 1/20 0.38
NPC1 O15118 1/20 0.38
TP53 P04637 1/20 0.38
HPGD P15428 1/20 0.38
RAB9A P51151 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30378054 1.00 TTR (0.47) TTRALDH1A1SMN1; SMN2KDM4ELMNA
SCHEMBL29984 0.87 ALDH1A1 (0.43) TTRALDH1A1SMN1; SMN2KDM4ELMNA
SCHEMBL9265274 0.83 TTR (0.65) TTRALDH1A1SMN1; SMN2KDM4ELMNA
SCHEMBL8683891 0.81 KMT2A (0.43) ALDH1A1SMN1; SMN2LMNAHTR2ASLC6A4
SCHEMBL8551788 0.81 F2 (0.50) TTRALDH1A1SMN1; SMN2KDM4ELMNA
SCHEMBL9272342 0.81 MAPT (0.50) TTRALDH1A1SMN1; SMN2KDM4ELMNA
SCHEMBL9762708 0.81 TTR (0.42) TTRALDH1A1SMN1; SMN2KDM4ELMNA
SCHEMBL6142404 0.81 TTR (0.47) TTRALDH1A1SMN1; SMN2KDM4ELMNA
SCHEMBL754458 0.80 LMNA (0.45) ALDH1A1SMN1; SMN2LMNAPOLBNPC1
SCHEMBL2545532 0.80 LMNA (0.45) ALDH1A1SMN1; SMN2LMNAPOLBNPC1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111840271-B Novel application of glycoside derivative 北京盈科瑞创新药物研究有限公司 2024-05-14 CN disclosed
CN-111471032-B Synthesis method of glycoside derivative, intermediate and application thereof 北京盈科瑞创新药物研究有限公司 2023-08-01 CN disclosed
CN-111471040-B Synthesis method of glycoside derivative, intermediate and application thereof 北京盈科瑞创新药物研究有限公司 2023-06-02 CN disclosed
CN-111471031-B Glycoside derivative and preparation method and application thereof 北京盈科瑞创新药物研究有限公司 2023-05-16 CN disclosed
US-8916589-B2 Bradykinin B1-antagonists BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-12-23 US disclosed
EP-2188254-B1 NOVEL BRADYKININ B1-ANTAGONISTS BOEHRINGER INGELHEIM INT (DE) 2012-03-21 EP disclosed
US-20110263626-A1 NOVEL BRADYKININ B1-ANTAGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-10-27 US disclosed
EP-2188254-A1 NOVEL BRADYKININ B1-ANTAGONISTS Boehringer Ingelheim International GmbH (DE) 2010-05-26 EP disclosed
WO-2009027450-A1 NOVEL BRADYKININ B1-ANTAGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-03-05 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110263626-A1 NOVEL BRADYKININ B1-ANTAGONISTS BDKRB1, BDKRB2, EDNRB TTR 3260/4885ALDH1A1 2920/4885SMN1; SMN2 4189/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.